13-(4-tert-butylphenoxy)-8-ethanoyl-12-oxidanyl-tridecanoic acid

Systemtic Name: 13-(4-tert-butylphenoxy)-8-ethanoyl-12-oxidanyl-tridecanoic acid Openeye Name: 8-acetyl-13-(4-tert-butylphenoxy)-12-hydroxy-tridecanoic acid CAS Name: 8-acetyl-13-(4-tert-butylphenoxy)-12-hydroxytridecanoic acid IUPAC Name: 8-acetyl-13-(4-tert-butylphenoxy)-12-hydroxytridecanoic acid Traditional Name: 8-acetyl-13-(4-tert-butylphenoxy)-12-hydroxy-tridecanoic acid Formula: C25H40O5 MolecularWeight: 420.5821

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCCCC(=O)O)CCCC(COC1=CC=C(C=C1)C(C)(C)C)O

Isomeric SMILES

CC(=O)C(CCCCCCC(=O)O)CCCC(COC1=CC=C(C=C1)C(C)(C)C)O

InChI

InChI=1S/C25H40O5/c1-19(26)20(10-7-5-6-8-13-24(28)29)11-9-12-22(27)18-30-23-16-14-21(15-17-23)25(2,3)4/h14-17,20,22,27H,5-13,18H2,1-4H3,(H,28,29)